5-[[4-(2-methylpropoxy)phenyl]methyl]-4-oxidanyl-2-[(phenylmethyl)amino]-1H-pyrimidin-6-one

Systemtic Name: 5-[[4-(2-methylpropoxy)phenyl]methyl]-4-oxidanyl-2-[(phenylmethyl)amino]-1H-pyrimidin-6-one Openeye Name: 2-(benzylamino)-4-hydroxy-5-[(4-isobutoxyphenyl)methyl]-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-[[4-(2-methylpropoxy)phenyl]methyl]-2-[(phenylmethyl)amino]-1H-pyrimidin-6-one IUPAC Name: 2-(benzylamino)-4-hydroxy-5-[[4-(2-methylpropoxy)phenyl]methyl]-1H-pyrimidin-6-one Traditional Name: 2-(benzylamino)-4-hydroxy-5-(4-isobutoxybenzyl)-1H-pyrimidin-6-one Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NCC3=CC=CC=C3)O

InChI

InChI=1S/C22H25N3O3/c1-15(2)14-28-18-10-8-16(9-11-18)12-19-20(26)24-22(25-21(19)27)23-13-17-6-4-3-5-7-17/h3-11,15H,12-14H2,1-2H3,(H3,23,24,25,26,27)